SCHEMBL8450146

SCHEMBL8450146

CC(=O)Nc1ccc(OC(=O)CCN(CC(C)C)C(=O)N[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.47
ACE P12821 4/20 0.47
TACR1 P25103 2/20 0.43
CTSB P07858 1/20 0.43
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PLG P00747 1/20 0.42
PLAU P00749 1/20 0.42
PLAT P00750 1/20 0.42
HDAC8 Q9BY41 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
CTSL P07711 1/20 0.39
CTSK P43235 1/20 0.39
POLB P06746 1/20 0.38
ACACB O00763 1/20 0.38
MMP1 P03956 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7568441 0.91 MME (0.58) MMEACEKMT2A
SCHEMBL8451194 0.86 MME (0.57) MMEACETACR1CTSBMEN1
SCHEMBL8452063 0.86 MME (0.57) MMEACETACR1CTSBMEN1
SCHEMBL8447155 0.85 MME (0.56) MMEACETACR1CTSBMEN1
SCHEMBL8450008 0.84 MME (0.55) MMEACETACR1CTSBMEN1
SCHEMBL8446466 0.84 MME (0.59) MMEACETACR1CTSBMEN1
SCHEMBL8451844 0.84 MME (0.51) MMEACETACR1CTSBMEN1
SCHEMBL8446424 0.83 MME (0.54) MMEACETACR1CTSBMEN1
SCHEMBL8452065 0.83 MME (0.54) MMEACETACR1CTSBMEN1
SCHEMBL8450134 0.83 MMEL1 (0.48) MMEACETACR1CTSBMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed